Vitas-M small molecule compound
(5Z)-5-[(1-cyclohexyl-2,5-dimethyl-1H-pyrrol-3-yl)methylidene]-1-(furan-2-ylmethyl)pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STK364832
SMILES O=C1NC(=O)N(C(=O)/C/1=C\c1cc(n(c1C)C1CCCCC1)C)Cc1ccco1
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C22H25N3O4 MW 395.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25N3O4/c1-14-11-16(15(2)25(14)17-7-4-3-5-8-17)12-19-20(26)23-22(28)24(21(19)27)13-18-9-6-10-29-18/h6,9-12,17H,3-5,7-8,13H2,1-2H3,(H,23,26,28)/b19-12-InChIKey
BEZNITMERCOOHX-UNOMPAQXSA-NSynonyms
6368-56-5(5Z)5((1CYCLOHEXYL25DIMETHYL1HPYRROL3YL)METHYLIDENE)1(FURAN2YLMETHYL)PYRIMIDINE246(1H3H5H)TRIONE
(5Z)5((1CYCLOHEXYL25DIMETHYLPYRROL3YL)METHYLIDENE)1(FURAN2YLMETHYL)13DIAZINANE246TRIONE
(E)5((1cyclohexyl25dimethyl1Hpyrrol3yl)methylene)1(furan2ylmethyl)pyrimidine246(1H3H5H)trione
6368565
CC1=CC(=C(N1C2CCCCC2)C)C=C3C(=O)NC(=O)N(C3=O)CC4=CC=CO4
InChI=1SC22H25N3O4c1141116(15(2)25(14)177435817)121920(26)2322(28)24(21(19)27)131896102918h691217H357813H212H3(H232628)b1912
MFCD02196126
ZINC000015800033
ZINC15800033
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